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CAS No.: | 500912-17-4 |
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Name: | 2-FLUORO-6-METHOXYBENZYL ALCOHOL |
Molecular Structure: | |
Formula: | C8H9FO2 |
Molecular Weight: | 219.053 |
Synonyms: | 2-Fluoro-6-methoxybenzylbromide;2-Fluoro-6-methoxybenzyl alcohol; |
Density: | 1.488 g/cm3 |
Melting Point: | 18-21°C |
Boiling Point: | 216 °C at 760 mmHg |
Flash Point: | 102.4 °C |
Hazard Symbols: | C |
Risk Codes: | 22 |
Transport Information: | UN1760 |
PSA: | 9.23000 |
LogP: | 2.72920 |
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The CAS register number of Benzene,2-(bromomethyl)-1-fluoro-3-methoxy- is 500912-17-4. It also can be called as 2-Fluoro-6-methoxybenzyl alcohol and the systematic name about this chemical is 2-(bromomethyl)-1-fluoro-3-methoxybenzene. The molecular formula about this chemical is C8H9FO2 and the molecular weight is 156.15. It belongs to the following product categories which include Aromatic Halides (substituted) and so on. This chemical may destroy living tissue on contact. It is corrosive and lachrymatory.
Physical properties about Benzene,2-(bromomethyl)-1-fluoro-3-methoxy- are: (1)ACD/LogP: 2.94; (2)ACD/LogD (pH 5.5): 2.94; (3)ACD/LogD (pH 7.4): 2.94; (4)ACD/BCF (pH 5.5): 100.33; (5)ACD/BCF (pH 7.4): 100.33; (6)ACD/KOC (pH 5.5): 942.42; (7)ACD/KOC (pH 7.4): 942.42; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 9.23 Å2; (11)Index of Refraction: 1.531; (12)Molar Refractivity: 45.57 cm3; (13)Molar Volume: 147.1 cm3; (14)Polarizability: 18.06x10-24cm3; (15)Surface Tension: 35.8 dyne/cm; (16)Density: 1.488 g/cm3; (17)Flash Point: 102.4 °C; (18)Enthalpy of Vaporization: 43.39 kJ/mol; (19)Boiling Point: 216 °C at 760 mmHg; (20)Vapour Pressure: 0.21 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccc(OC)c1CBr
(2)InChI: InChI=1/C8H8BrFO/c1-11-8-4-2-3-7(10)6(8)5-9/h2-4H,5H2,1H3
(3)InChIKey: PVKFBCBTHHTDEX-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C8H8BrFO/c1-11-8-4-2-3-7(10)6(8)5-9/h2-4H,5H2,1H3
(5)Std. InChIKey: PVKFBCBTHHTDEX-UHFFFAOYSA-N